CID 9608156

2-(4-bromophenoxy)-n'-(3-phenyl-2-propenylidene)acetohydrazide

Structural Information

Molecular Formula
C17H15BrN2O2
SMILES
C1=CC=C(C=C1)/C=C/C=N/NC(=O)COC2=CC=C(C=C2)Br
InChI
InChI=1S/C17H15BrN2O2/c18-15-8-10-16(11-9-15)22-13-17(21)20-19-12-4-7-14-5-2-1-3-6-14/h1-12H,13H2,(H,20,21)/b7-4+,19-12+
InChIKey
ILJBFZJOORVGSW-MZBBQUMVSA-N
Compound name
2-(4-bromophenoxy)-N-[(E)-[(E)-3-phenylprop-2-enylidene]amino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

358.03168 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 359.03896 174.1
[M+Na]+ 381.02090 182.2
[M-H]- 357.02440 183.5
[M+NH4]+ 376.06550 190.0
[M+K]+ 396.99484 169.5
[M+H-H2O]+ 341.02894 170.8
[M+HCOO]- 403.02988 198.0
[M+CH3COO]- 417.04553 213.3
[M+Na-2H]- 379.00635 180.4
[M]+ 358.03113 193.2
[M]- 358.03223 193.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.